SCHEMBL15865746

SCHEMBL15865746

CCCCC1CCC(C2CCC(/C=C/C3CCCCC3)CC2)CC1

nearest known ligand 0.59

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.59
LMNA P02545 1/20 0.38
MAPK1 P28482 1/20 0.38
HTT P42858 1/20 0.38
SIGMAR1 Q99720 3/20 0.34
MAPT P10636 1/20 0.34
NOS1 P29475 2/20 0.33
NOS2 P35228 2/20 0.33
POLB P06746 1/20 0.33
HPGD P15428 1/20 0.33
NFKB1 P19838 1/20 0.31
NFKB2 Q00653 1/20 0.31
RELA Q04206 1/20 0.31
DPP4 P27487 1/20 0.30
TLR7 Q9NYK1 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL7558254 0.91 CYP1A2 (0.52) CYP1A2LMNAMAPK1HTTSIGMAR1
SCHEMBL7558262 0.91 CYP1A2 (0.52) CYP1A2LMNAMAPK1HTTSIGMAR1
SCHEMBL7558256 0.91 CYP1A2 (0.52) CYP1A2LMNAMAPK1HTTSIGMAR1
SCHEMBL7558260 0.91 CYP1A2 (0.52) CYP1A2LMNAMAPK1HTTSIGMAR1
Methyl Alcohol SCHEMBL7558879 0.88 CYP1A2 (0.48) CYP1A2LMNAMAPK1HTTSIGMAR1
Methyl Alcohol SCHEMBL7560350 0.88 CYP1A2 (0.48) CYP1A2LMNAMAPK1HTTSIGMAR1
SCHEMBL25118148 0.84 CYP1A2 (0.45) CYP1A2LMNAMAPK1HTTMAPT
SCHEMBL7556351 0.84 CYP1A2 (0.41) CYP1A2LMNAMAPK1HTTMAPT
SCHEMBL7557945 0.84 CYP1A2 (0.41) CYP1A2LMNAMAPK1HTTMAPT
SCHEMBL7557941 0.84 CYP1A2 (0.41) CYP1A2LMNAMAPK1HTTMAPT

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8771809-B2 Photoalignment material, display substrate having an alignment layer formed using the same, and method of manufacturing the display substrate SAMSUNG DISPLAY CO., LTD. (KR) 2014-07-08 US disclosed